3-(2-bromanyl-4,6-dimethyl-phenoxy)propyl-cyclopentyl-azanium

Systemtic Name: 3-(2-bromanyl-4,6-dimethyl-phenoxy)propyl-cyclopentyl-azanium Openeye Name: 3-(2-bromo-4,6-dimethyl-phenoxy)propyl-cyclopentyl-ammonium CAS Name: 3-(2-bromo-4,6-dimethylphenoxy)propyl-cyclopentylammonium IUPAC Name: 3-(2-bromo-4,6-dimethylphenoxy)propyl-cyclopentylazanium Traditional Name: 3-(2-bromo-4,6-dimethyl-phenoxy)propyl-cyclopentyl-ammonium Formula: C16H25BrNO+ MolecularWeight: 327.2798

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)Br)OCCC[NH2+]C2CCCC2)C

Isomeric SMILES

CC1=CC(=C(C(=C1)Br)OCCC[NH2+]C2CCCC2)C

InChI

InChI=1S/C16H24BrNO/c1-12-10-13(2)16(15(17)11-12)19-9-5-8-18-14-6-3-4-7-14/h10-11,14,18H,3-9H2,1-2H3/p+1